« first day (927 days earlier)      last day (464 days later) » 

4:57 PM
0
Q: Error termination by gaussian just before the calculation ends

Kamal SobhyI am trying to optimize a cluster based structure using DFT. However, just before the calculation ends the gaussian give me an error termination without even specifying the cause of this error # Opt=(Restart,Loose,Cartesian) ub3lyp/genecp/auto geom=connectivity NOSYMM scf=(maxcycle=500, Maxconven...

 

« first day (927 days earlier)      last day (464 days later) »